COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK837408
Chemical Name: (2E)-1-{3-[(2-oxo-2-phenylethyl)sulfanyl]-4H-1,2,4-triazol-4-yl}-3-(thiophen-2-yl)prop-2-en-1-one
Smiles: O=C(c1ccccc1)CSc1nncn1C(=O)/C=C/c1cccs1

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Molecular Weight: 355.44
Empirical Formula: C17H13N3O2S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 118
Number of rings: 3

     

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